1-[2-(3-oxidanylidenebutanethioylamino)ethanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-(3-oxidanylidenebutanethioylamino)ethanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-(3-oxobutanethioylamino)acetyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[1-oxo-2-[(3-oxo-1-sulfanylidenebutyl)amino]ethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-(3-oxobutanethioylamino)acetyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-(3-ketobutanethioylamino)acetyl]proline Formula: C11H16N2O4S MolecularWeight: 272.32074

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=S)NCC(=O)N1CCCC1C(=O)O

Isomeric SMILES

CC(=O)CC(=S)NCC(=O)N1CCCC1C(=O)O

InChI

InChI=1S/C11H16N2O4S/c1-7(14)5-9(18)12-6-10(15)13-4-2-3-8(13)11(16)17/h8H,2-6H2,1H3,(H,12,18)(H,16,17)